9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine

C11H21N3 — CID 79498909

IUPAC9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine
SMILESCC(C)N1C(N)=NCC12CCCC2C
InChIInChI=1S/C11H21N3/c1-8(2)14-10(12)13-7-11(14)6-4-5-9(11)3/h8-9H,4-7H2,1-3H3,(H2,12,13)
InChIKeyCDBBFWNGFAUCQX-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.58
Rot. Bonds1

About 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine

9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine (PubChem CID 79498909) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine.

Molecular Properties

Compound Name9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine
PubChem CID79498909
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine
SMILESCC(C)N1C(N)=NCC12CCCC2C
InChIInChI=1S/C11H21N3/c1-8(2)14-10(12)13-7-11(14)6-4-5-9(11)3/h8-9H,4-7H2,1-3H3,(H2,12,13)
InChIKeyCDBBFWNGFAUCQX-UHFFFAOYSA-N
XLogP1.58
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine?
The IUPAC name of 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine (CID 79498909) is 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine.
What is the SMILES notation for 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine?
The canonical SMILES for 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine is CC(C)N1C(N)=NCC12CCCC2C.
What is the InChIKey of 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine?
The InChIKey is CDBBFWNGFAUCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-8(2)14-10(12)13-7-11(14)6-4-5-9(11)3/h8-9H,4-7H2,1-3H3,(H2,12,13).
What are the key properties of 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine?
9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine has a molecular weight of 195.31 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-2-en-2-amine is sourced from PubChem (CID 79498909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).